TL;DR: 2-[(E)-(1-benzyl-2-oxoindol-3-ylidene)methyl]-3-(2-methoxyphenyl)quinazolin-4-one (CAS 371782-40-0) is a chemical compound with molecular formula C31H23N3O3 and molecular weight 485.17395 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(E)-(1-benzyl-2-oxoindol-3-ylidene)methyl]-3-(2-methoxyphenyl)quinazolin-4-one
Also Known As: 2-[(E)-(1-benzyl-2-oxoindol-3-ylidene)methyl]-3-(2-methoxyphenyl)quinazolin-4-one, 2-[(1-benzyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(2-methoxyphenyl)-4(3H)-quinazolinone
| Molecular Formula | C31H23N3O3 |
| Molecular Weight | 485.17395 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 62.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 485.17395 Da |
| Heavy Atoms | 37 |
| Complexity | 923.0 |
| SMILES | COC1=CC=CC=C1N2C(=NC3=CC=CC=C3C2=O)/C=C/4\C5=CC=CC=C5N(C4=O)CC6=CC=CC=C6 |
| InChIKey | OXDZCCMIWYHKHU-LYBHJNIJSA-N |
The XLogP value of 4.9 indicates that 2-[(E)-(1-benzyl-2-oxoindol-3-ylidene)methyl]-3-(2-methoxyphenyl)quinazolin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(E)-(1-benzyl-2-oxoindol-3-ylidene)methyl]-3-(2-methoxyphenyl)quinazolin-4-one. Following Lipinski's Rule of Five, 2-[(E)-(1-benzyl-2-oxoindol-3-ylidene)methyl]-3-(2-methoxyphenyl)quinazolin-4-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[(E)-(1-benzyl-2-oxoindol-3-ylidene)methyl]-3-(2-methoxyphenyl)quinazolin-4-one is 371782-40-0.
The molecular formula of 2-[(E)-(1-benzyl-2-oxoindol-3-ylidene)methyl]-3-(2-methoxyphenyl)quinazolin-4-one is C31H23N3O3.
The molecular weight of 2-[(E)-(1-benzyl-2-oxoindol-3-ylidene)methyl]-3-(2-methoxyphenyl)quinazolin-4-one is 485.17395 g/mol.
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